Geometry & MOs

Info

ID:	309059
PubChem CID:	126535744
Reduced:	H2O2C3 (3)
Stoich.:	A2B2C3 (3)
Weight, g/mol:	483.218287
ΔH_f, kcal/mol:	-202.61
Dipole, Da:	8.11
IP(EA), eV:	-11.71(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-7-[3-fluoro-5-(2-pyrrolidin-1-ylethoxy)phenyl]-2-[5-(4-methylpyridin-3-yl)-1,2-dihydropyrazol-3-ylidene]imidazo[4,5-b]pyridine

Drug info:

PubChemData

Smile

C1C2C3C(C3C(=O)OC2=O)C(=O)OC1=O

DOS

IR

Vibrations